4-(2-oxoimidazolidin-1-yl)-N-(3,4,5-trimethoxyphenyl)benzenesulfonamide

C18H21N3O6S — CID 56931307

IUPAC4-(2-oxoimidazolidin-1-yl)-N-(3,4,5-trimethoxyphenyl)benzenesulfonamide
SMILESCOc1cc(NS(=O)(=O)c2ccc(N3CCNC3=O)cc2)cc(OC)c1OC
InChIInChI=1S/C18H21N3O6S/c1-25-15-10-12(11-16(26-2)17(15)27-3)20-28(23,24)14-6-4-13(5-7-14)21-9-8-19-18(21)22/h4-7,10-11,20H,8-9H2,1-3H3,(H,19,22)
InChIKeyFQLKPVBWUPASHV-UHFFFAOYSA-N
MW407.45 g/mol
LogP2.04
Rot. Bonds7

About 4-(2-oxoimidazolidin-1-yl)-N-(3,4,5-trimethoxyphenyl)benzenesulfonamide

4-(2-oxoimidazolidin-1-yl)-N-(3,4,5-trimethoxyphenyl)benzenesulfonamide (PubChem CID 56931307) has the molecular formula C18H21N3O6S and a molecular weight of 407.45 g/mol. Its IUPAC name is 4-(2-oxoimidazolidin-1-yl)-N-(3,4,5-trimethoxyphenyl)benzenesulfonamide.

Molecular Properties

Compound Name4-(2-oxoimidazolidin-1-yl)-N-(3,4,5-trimethoxyphenyl)benzenesulfonamide
PubChem CID56931307
Molecular FormulaC18H21N3O6S
Molecular Weight407.45 g/mol
Exact Mass407.12
IUPAC Name4-(2-oxoimidazolidin-1-yl)-N-(3,4,5-trimethoxyphenyl)benzenesulfonamide
SMILESCOc1cc(NS(=O)(=O)c2ccc(N3CCNC3=O)cc2)cc(OC)c1OC
InChIInChI=1S/C18H21N3O6S/c1-25-15-10-12(11-16(26-2)17(15)27-3)20-28(23,24)14-6-4-13(5-7-14)21-9-8-19-18(21)22/h4-7,10-11,20H,8-9H2,1-3H3,(H,19,22)
InChIKeyFQLKPVBWUPASHV-UHFFFAOYSA-N
XLogP2.04
TPSA106.20 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.45
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-(2-oxoimidazolidin-1-yl)-N-(3,4,5-trimethoxyphenyl)benzenesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(2-oxoimidazolidin-1-yl)-N-(3,4,5-trimethoxyphenyl)benzenesulfonamide?
The IUPAC name of 4-(2-oxoimidazolidin-1-yl)-N-(3,4,5-trimethoxyphenyl)benzenesulfonamide (CID 56931307) is 4-(2-oxoimidazolidin-1-yl)-N-(3,4,5-trimethoxyphenyl)benzenesulfonamide.
What is the SMILES notation for 4-(2-oxoimidazolidin-1-yl)-N-(3,4,5-trimethoxyphenyl)benzenesulfonamide?
The canonical SMILES for 4-(2-oxoimidazolidin-1-yl)-N-(3,4,5-trimethoxyphenyl)benzenesulfonamide is COc1cc(NS(=O)(=O)c2ccc(N3CCNC3=O)cc2)cc(OC)c1OC.
What is the InChIKey of 4-(2-oxoimidazolidin-1-yl)-N-(3,4,5-trimethoxyphenyl)benzenesulfonamide?
The InChIKey is FQLKPVBWUPASHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O6S/c1-25-15-10-12(11-16(26-2)17(15)27-3)20-28(23,24)14-6-4-13(5-7-14)21-9-8-19-18(21)22/h4-7,10-11,20H,8-9H2,1-3H3,(H,19,22).
What are the key properties of 4-(2-oxoimidazolidin-1-yl)-N-(3,4,5-trimethoxyphenyl)benzenesulfonamide?
4-(2-oxoimidazolidin-1-yl)-N-(3,4,5-trimethoxyphenyl)benzenesulfonamide has a molecular weight of 407.45 g/mol, XLogP of 2.04, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-oxoimidazolidin-1-yl)-N-(3,4,5-trimethoxyphenyl)benzenesulfonamide is sourced from PubChem (CID 56931307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).